HRID89016

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID66053

N,N-Dimethylethylenediamine

C4H12N2

HCID100117

未命名化合物

HCID178501693

未命名化合物

PRODUCTS

产物

HCID178501670

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-1335f4b0ad344a508af3fc6c5c14d385
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([CH2:10][c:11]1[cH:12][cH:13][c:14]([OH:17])[cH:15][cH:16]1)[C:18](=[O:19])[OH:20].[CH2:28]([O:29][C:30]([Cl:31])=[O:32])[CH:33]([CH3:34])[CH3:35].[CH3:21][N:22]1[CH2:23][CH2:24][O:25][CH2:26][CH2:27]1.[CH3:51][N:52]([CH3:53])[CH2:54][CH2:55][NH2:56].[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[ClH:36].[NH2:37][CH:38]([CH2:39][CH2:40][S:41][CH3:42])[C:43](=[O:44])[NH:45][CH2:46][C:47](=[O:48])[O:49][CH3:50]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([CH2:10][c:11]1[cH:12][cH:13][c:14]([OH:17])[cH:15][cH:16]1)[C:18](=[O:20])[NH:37][CH:38]([CH2:39][CH2:40][S:41][CH3:42])[C:43](=[O:44])[NH:45][CH2:46][C:47](=[O:48])[O:49][CH3:50]